LAMMPS (18 Feb 2013)
units		metal
atom_style	charge
dimension       3
boundary        p p p

read_data  	data.m-HfO2
  triclinic box = (0 0 0) to (25.642 25.957 26.4845) with tilt (0 -4.46691 0)
  1 by 1 by 1 MPI processor grid
  1500 atoms
#read_data  	data.t-HfO2
#read_data  	data.c-HfO2

mass		1 178.0
group    	type1 type 1
500 atoms in group type1
compute   	charge1 type1 property/atom q
compute   	q1 type1 reduce ave c_charge1
mass		2 16.00
group    	type2 type 2
1000 atoms in group type2
compute   	charge2 type2 property/atom q
compute   	q2 type2 reduce ave c_charge2

pair_style	comb
pair_coeff	* * ffield.comb Hf O

neighbor	0.5 bin
neigh_modify	every 10 delay 10 check yes

timestep        0.00020

thermo_style	custom step temp etotal pe evdwl ecoul press vol lx ly lz xz c_q1 c_q2
thermo_modify	norm yes

fix		1 all nvt temp 300.0 300.0 0.1
thermo      	1
run    		1
Memory usage per processor = 9.38262 Mbytes
Step Temp TotEng PotEng E_vdwl E_coul Press Volume Lx Ly Lz Xz q1 q2 
       0            0   -9.5079733   -9.5079733    5.1477526   -14.655726    -137492.1    17627.802       25.642       25.957      26.4845     -4.46691          3.6         -1.8 
       1   0.10158794   -9.5079736   -9.5079867     5.147743    -14.65573   -137441.67    17627.802       25.642       25.957      26.4845     -4.46691          3.6         -1.8 
Loop time of 0.121043 on 1 procs for 1 steps with 1500 atoms

Pair  time (%) = 0.120863 (99.8511)
Neigh time (%) = 0 (0)
Comm  time (%) = 8.4877e-05 (0.0701213)
Outpt time (%) = 3.31402e-05 (0.0273788)
Other time (%) = 6.22272e-05 (0.0514091)

Nlocal:    1500 ave 1500 max 1500 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    10100 ave 10100 max 10100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  1.0375e+06 ave 1.0375e+06 max 1.0375e+06 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1037500
Ave neighs/atom = 691.667
Neighbor list builds = 0
Dangerous builds = 0
fix  		2 all qeq/comb 1 0.003 file fq.out
run    		5
Memory usage per processor = 10.508 Mbytes
Step Temp TotEng PotEng E_vdwl E_coul Press Volume Lx Ly Lz Xz q1 q2 
       1   0.10158794   -9.5079736   -9.5079867     5.147743    -14.65573   -137441.67    17627.802       25.642       25.957      26.4845     -4.46691    3.3487003   -1.6743501 
       2   0.44611424   -10.177672    -10.17773    2.5152099    -12.69294   -408898.04    17627.802       25.642       25.957      26.4845     -4.46691    3.3487003   -1.6743501 
       3    1.1091377   -10.177676    -10.17782    2.5151362   -12.692956   -408487.56    17627.802       25.642       25.957      26.4845     -4.46691    3.3487003   -1.6743501 
       4    2.0744017   -10.177683   -10.177951    2.5150272   -12.692978   -407877.44    17627.802       25.642       25.957      26.4845     -4.46691    3.3487003   -1.6743501 
       5    3.3393343   -10.177692   -10.178123    2.5148832   -12.693006   -407066.63    17627.802       25.642       25.957      26.4845     -4.46691    3.3487003   -1.6743501 
       6    4.9005371   -10.177703   -10.178336    2.5147047   -12.693041   -406053.73    17627.802       25.642       25.957      26.4845     -4.46691    3.3487003   -1.6743501 
Loop time of 0.836517 on 1 procs for 5 steps with 1500 atoms

Pair  time (%) = 0.604237 (72.2325)
Neigh time (%) = 0 (0)
Comm  time (%) = 0.000416756 (0.0498204)
Outpt time (%) = 0.000157833 (0.0188679)
Other time (%) = 0.231705 (27.6988)

Nlocal:    1500 ave 1500 max 1500 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    10100 ave 10100 max 10100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  1.0375e+06 ave 1.0375e+06 max 1.0375e+06 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1037500
Ave neighs/atom = 691.667
Neighbor list builds = 0
Dangerous builds = 0

unfix    	1
fix		1 all box/relax aniso 0.0 vmax 0.0002
minimize	1.0e-12  1.0e-18  1000  10000
WARNING: Resetting reneighboring criteria during minimization (min.cpp:173)
Memory usage per processor = 11.9842 Mbytes
Step Temp TotEng PotEng E_vdwl E_coul Press Volume Lx Ly Lz Xz q1 q2 
       6    4.9005371   -10.177703   -10.178336    2.5147047   -12.693041   -406053.73    17627.802       25.642       25.957      26.4845     -4.46691    3.3487003   -1.6743501 
       7    4.9005371   -10.179122   -10.179755    2.5134924   -12.693247   -399211.14    17620.846    25.636872    25.952767    26.483664   -4.4667689    3.3487003   -1.6743501 
       8    4.9005371   -10.180516   -10.181149    2.5123069   -12.693456   -392200.95    17613.885    25.631743    25.948534    26.482818   -4.4666263    3.3487003   -1.6743501 
       9    4.9005371   -10.181882   -10.182515    2.5111487   -12.693664   -385024.22    17606.918    25.626615    25.944298    26.481963   -4.4664821    3.3487003   -1.6743501 
      10    4.9005371    -10.18322   -10.183853    2.5100185   -12.693872   -377684.02    17599.945    25.621486    25.940062    26.481097   -4.4663361    3.3487003   -1.6743501 
      11    4.9005371   -10.184531   -10.185164     2.508917   -12.694081   -370183.53    17592.964    25.616358    25.935823     26.48022   -4.4661881    3.3487003   -1.6743501 
      12    4.9005371    -10.18581   -10.186443    2.5078447   -12.694287   -362524.12    17585.976     25.61123    25.931583    26.479331   -4.4660381    3.3487003   -1.6743501 
      13    4.9005371   -10.187061   -10.187694    2.5068022   -12.694496   -354711.13    17578.979    25.606101    25.927341    26.478428   -4.4658859    3.3487003   -1.6743501 
      14    4.9005371   -10.188281   -10.188914    2.5057902   -12.694704   -346745.81    17571.973    25.600973    25.923098    26.477512   -4.4657313    3.3487003   -1.6743501 
      15    4.9005371   -10.189469   -10.190102    2.5048092   -12.694911   -338631.19    17564.957    25.595844    25.918852     26.47658   -4.4655742    3.3487003   -1.6743501 
      16    4.9005371   -10.190627    -10.19126    2.5038597   -12.695119   -330371.37    17557.931    25.590716    25.914603    26.475632   -4.4654143    3.3487003   -1.6743501 
      17    4.9005371    -10.19175   -10.192383    2.5029424   -12.695325   -321967.67    17550.893    25.585588    25.910353    26.474666   -4.4652514    3.3487003   -1.6743501 
      18    4.9005371    -10.19284   -10.193473    2.5020578   -12.695531   -313424.33    17543.842    25.580459    25.906099    26.473681   -4.4650853    3.3487003   -1.6743501 
      19    4.9005371   -10.193897    -10.19453    2.5012064   -12.695737   -304744.97    17536.777    25.575331    25.901843    26.472676   -4.4649157    3.3487003   -1.6743501 
      20    4.9005371   -10.195049   -10.195682    2.5002594   -12.695942   -295752.55    17529.697    25.570202    25.897584    26.471648   -4.4647424    3.3487003   -1.6743501 
      21    4.9005371   -10.196037    -10.19667    2.4994765   -12.696146   -286810.19    17522.602    25.565074    25.893323    26.470598   -4.4645653    3.3487003   -1.6743501 
      22    4.9005371   -10.196988   -10.197621    2.4987283   -12.696349   -277740.46     17515.49    25.559946    25.889059    26.469523   -4.4643839    3.3487003   -1.6743501 
      23    4.9005371   -10.197903   -10.198536    2.4980153   -12.696552   -268547.09    17508.358    25.554817     25.88479    26.468418   -4.4641976    3.3487003   -1.6743501 
      24    4.9005371   -10.198782   -10.199415     2.497338   -12.696753   -259232.88    17501.204    25.549689    25.880518    26.467283   -4.4640061    3.3487003   -1.6743501 
      25    4.9005371   -10.199623   -10.200256    2.4966969   -12.696953    -249801.3    17494.027     25.54456    25.876241    26.466113   -4.4638088    3.3487003   -1.6743501 
      26    4.9005371   -10.200428   -10.201061    2.4960923   -12.697154   -240255.95    17486.823    25.539432     25.87196    26.464906   -4.4636052    3.3487003   -1.6743501 
      27    4.9005371   -10.201196   -10.201829    2.4955247   -12.697353   -230599.57    17479.589    25.534304    25.867673    26.463657   -4.4633945    3.3487003   -1.6743501 
      28    4.9005371   -10.201927    -10.20256    2.4949946   -12.697554   -220836.27    17472.324    25.529175     25.86338    26.462362   -4.4631762    3.3487003   -1.6743501 
      29    4.9005371    -10.20262   -10.203253    2.4945024   -12.697756    -210968.3    17465.022    25.524047     25.85908    26.461016   -4.4629492    3.3487003   -1.6743501 
      30    4.9005371   -10.203281   -10.203914    2.4940484   -12.697962   -201001.66    17457.679    25.518918    25.854774    26.459613   -4.4627126    3.3487003   -1.6743501 
      31    4.9005371   -10.203904   -10.204537    2.4936332    -12.69817   -190935.91     17450.29     25.51379     25.85046    26.458146   -4.4624651    3.3487003   -1.6743501 
      32    4.9005371   -10.204488   -10.205121     2.493257   -12.698378   -180773.29     17442.85    25.508662    25.846136    26.456606   -4.4622054    3.3487003   -1.6743501 
      33    4.9005371   -10.205037    -10.20567    2.4929204   -12.698591   -170517.54    17435.349    25.503533    25.841802    26.454984   -4.4619318    3.3487003   -1.6743501 
      34    4.9005371   -10.205549   -10.206182    2.4926237   -12.698806   -160169.44    17427.781    25.498405    25.837457    26.453266   -4.4616421    3.3487003   -1.6743501 
      35    4.9005371   -10.206023   -10.206656    2.4923673   -12.699023   -149728.79    17420.132    25.493276    25.833098    26.451438   -4.4613337    3.3487003   -1.6743501 
      36    4.9005371   -10.206456   -10.207089    2.4921518   -12.699241   -139194.99    17412.389    25.488148    25.828724     26.44948   -4.4610034    3.3487003   -1.6743501 
      37    4.9005371   -10.206852   -10.207486    2.4919775   -12.699463   -128568.57    17404.534     25.48302    25.824331    26.447367   -4.4606471    3.3487003   -1.6743501 
      38    4.9005371   -10.207211   -10.207844     2.491845   -12.699689   -117845.52    17396.543    25.477891    25.819915    26.445067   -4.4602591    3.3487003   -1.6743501 
      39    4.9005371    -10.20753   -10.208164     2.491755   -12.699918   -107020.01    17388.383    25.472763    25.815472    26.442534    -4.459832    3.3487003   -1.6743501 
      40    4.9005371   -10.207815   -10.208448    2.4917081   -12.700156   -96083.354    17380.008    25.467634    25.810993    26.439708   -4.4593554    3.3487003   -1.6743501 
      41    4.9005371   -10.208062   -10.208695    2.4917053   -12.700401   -85018.286    17371.351    25.462506    25.806467    26.436497   -4.4588137    3.3487003   -1.6743501 
      42    4.9005371   -10.208271   -10.208904     2.491748   -12.700652   -73793.674    17362.307    25.457378    25.801878    26.432756   -4.4581829    3.3487003   -1.6743501 
      43    4.9005371   -10.208446   -10.209079    2.4918382   -12.700917   -62360.119    17352.697    25.452249    25.797196    26.428245   -4.4574219    3.3487003   -1.6743501 
      44    4.9005371   -10.208582   -10.209215     2.491967   -12.701182   -51542.505    17343.008    25.447525    25.792747    26.422948   -4.4565285    3.3487003   -1.6743501 
      45    4.9005371   -10.208681   -10.209314    2.4920939   -12.701408   -43273.049    17334.863     25.44406    25.789315    26.417651   -4.4556351    3.3487003   -1.6743501 
      46    4.9005371   -10.208759   -10.209393    2.4922069   -12.701599   -36997.799    17327.922    25.441576    25.786676    26.412354   -4.4547418    3.3487003   -1.6743501 
      47    4.9005371   -10.208834   -10.209467    2.4923019   -12.701769   -32264.505    17321.909    25.439848    25.784649    26.407057   -4.4538484    3.3487003   -1.6743501 
      48    4.9005371   -10.208909   -10.209542    2.4923792   -12.701921   -28705.843    17316.601    25.438696    25.783087     26.40176    -4.452955    3.3487003   -1.6743501 
      49    4.9005371   -10.208986   -10.209619    2.4924408    -12.70206   -26035.132    17311.825    25.437979    25.781876    26.396463   -4.4520616    3.3487003   -1.6743501 
      50    4.9005371   -10.209067     -10.2097    2.4924894   -12.702189   -24030.259    17307.449    25.437586    25.780929    26.391166   -4.4511682    3.3487003   -1.6743501 
      51    4.9005371   -10.209153   -10.209786    2.4925278   -12.702314   -22521.401    17303.368    25.437435    25.780178    26.385869   -4.4502748    3.3487003   -1.6743501 
      52    4.9005371   -10.209241   -10.209874    2.4925582   -12.702432   -21377.916    17299.506    25.437463    25.779571    26.380573   -4.4493815    3.3487003   -1.6743501 
      53    4.9005371    -10.20933   -10.209963    2.4925827   -12.702546   -20503.155    17295.805    25.437622    25.779072    26.375276   -4.4484881    3.3487003   -1.6743501 
      54    4.9005371    -10.20942   -10.210053    2.4926026   -12.702655   -19825.084    17292.222    25.437876     25.77865    26.369979   -4.4475947    3.3487003   -1.6743501 
      55    4.9005371    -10.20951   -10.210143    2.4926193   -12.702762   -19290.332    17288.725      25.4382    25.778286    26.364682   -4.4467013    3.3487003   -1.6743501 
      56    4.9005371   -10.209601   -10.210234    2.4926335   -12.702867   -18859.558    17285.289    25.438575    25.777963    26.359385   -4.4458079    3.3487003   -1.6743501 
      57    4.9005371   -10.209691   -10.210324    2.4926461    -12.70297   -18503.909    17281.899    25.438986     25.77767    26.354088   -4.4449146    3.3487003   -1.6743501 
      58    4.9005371   -10.209782   -10.210415    2.4926574   -12.703072    -18202.31    17278.541    25.439423    25.777399    26.348791   -4.4440212    3.3487003   -1.6743501 
      59    4.9005371   -10.209872   -10.210505    2.4926678   -12.703173    -17939.44    17275.206    25.439879    25.777144    26.343494   -4.4431278    3.3487003   -1.6743501 
      60    4.9005371   -10.209962   -10.210595    2.4926777   -12.703272   -17704.202    17271.887    25.440348    25.776901    26.338197   -4.4422344    3.3487003   -1.6743501 
      61    4.9005371   -10.210051   -10.210684    2.4926871   -12.703371   -17488.592    17268.581    25.440826    25.776666      26.3329    -4.441341    3.3487003   -1.6743501 
      62    4.9005371    -10.21014   -10.210773    2.4926963   -12.703469    -17286.86    17265.282    25.441311    25.776436    26.327604   -4.4404476    3.3487003   -1.6743501 
      63    4.9005371   -10.210227    -10.21086    2.4927054   -12.703566   -17094.395     17261.99    25.441799    25.776211    26.322307   -4.4395543    3.3487003   -1.6743501 
      64    4.9005371   -10.210317    -10.21095    2.4927143   -12.703664   -16910.273    17258.701    25.442291     25.77599     26.31701   -4.4386609    3.3487003   -1.6743501 
      65    4.9005371   -10.210403   -10.211036    2.4927232   -12.703759   -16729.397    17255.416    25.442785    25.775771    26.311713   -4.4377675    3.3487003   -1.6743501 
      66    4.9005371   -10.210491   -10.211124    2.4927321   -12.703856   -16553.119    17252.132    25.443279    25.775553    26.306416   -4.4368741    3.3487003   -1.6743501 
      67    4.9005371   -10.210578   -10.211211     2.492741   -12.703952   -16378.985    17248.849    25.443775    25.775338    26.301119   -4.4359807    3.3487003   -1.6743501 
      68    4.9005371   -10.210665   -10.211298      2.49275   -12.704048   -16206.061    17245.568     25.44427    25.775123    26.295822   -4.4350874    3.3487003   -1.6743501 
      69    4.9005371   -10.210751   -10.211384     2.492759   -12.704143   -16034.089    17242.287    25.444765     25.77491    26.290525    -4.434194    3.3487003   -1.6743501 
      70    4.9005371   -10.210836   -10.211469    2.4927681   -12.704237   -15862.739    17239.006     25.44526    25.774697    26.285228   -4.4333006    3.3487003   -1.6743501 
      71    4.9005371   -10.210921   -10.211554    2.4927772   -12.704331   -15691.781    17235.726    25.445755    25.774485    26.279931   -4.4324072    3.3487003   -1.6743501 
      72    4.9005371   -10.211005   -10.211638    2.4927864   -12.704424   -15521.058    17232.446     25.44625    25.774275    26.274635   -4.4315138    3.3487003   -1.6743501 
      73    4.9005371   -10.211088   -10.211721    2.4927957   -12.704517   -15350.462    17229.166    25.446743    25.774065    26.269338   -4.4306204    3.3487003   -1.6743501 
      74    4.9005371   -10.211171   -10.211804    2.4928051   -12.704609    -15179.92    17225.886    25.447237    25.773855    26.264041   -4.4297271    3.3487003   -1.6743501 
      75    4.9005371   -10.211253   -10.211887    2.4928145   -12.704701   -15009.382    17222.606    25.447729    25.773647    26.258744   -4.4288337    3.3487003   -1.6743501 
      76    4.9005371   -10.211335   -10.211968     2.492824   -12.704792   -14838.814    17219.326    25.448221    25.773439    26.253447   -4.4279403    3.3487003   -1.6743501 
      77    4.9005371   -10.211416   -10.212049    2.4928336   -12.704883   -14668.193    17216.046    25.448713    25.773232     26.24815   -4.4270469    3.3487003   -1.6743501 
      78    4.9005371   -10.211495   -10.212128    2.4928433   -12.704971   -14496.606    17212.766    25.449203    25.773026    26.242853   -4.4261535    3.3487003   -1.6743501 
      79    4.9005371   -10.211574   -10.212207     2.492853    -12.70506   -14326.218    17209.486    25.449694     25.77282    26.237556   -4.4252602    3.3487003   -1.6743501 
      80    4.9005371   -10.211653   -10.212286    2.4928628   -12.705149   -14155.606    17206.206    25.450183    25.772616    26.232259   -4.4243668    3.3487003   -1.6743501 
      81    4.9005371   -10.211693   -10.212326    2.4928678   -12.705194   -14070.237    17204.566    25.450428    25.772514    26.229611   -4.4239201    3.3487003   -1.6743501 
      82    4.9005371   -10.211712   -10.212345    2.4928703   -12.705216   -14027.539    17203.746     25.45055    25.772463    26.228287   -4.4236967    3.3487003   -1.6743501 
      83    4.9005371   -10.211717    -10.21235    2.4928709   -12.705221   -14016.863    17203.541     25.45058     25.77245    26.227956   -4.4236409    3.3487003   -1.6743501 
      84    4.9005371    -10.21172   -10.212353    2.4928712   -12.705224   -14011.525    17203.438    25.450596    25.772444     26.22779    -4.423613    3.3487003   -1.6743501 
      85    4.9005371   -10.211721   -10.212354    2.4928714   -12.705225   -14008.856    17203.387    25.450603    25.772441    26.227707    -4.423599    3.3487003   -1.6743501 
      86    4.9005371   -10.211721   -10.212354    2.4928714   -12.705225    -14008.69    17203.384    25.450604     25.77244    26.227702   -4.4235981    3.3487003   -1.6743501 
      87    4.9005371   -10.211721   -10.212354    2.4928714   -12.705225   -14008.606    17203.382    25.450604     25.77244      26.2277   -4.4235977    3.3487003   -1.6743501 
      88    4.9005371   -10.211721   -10.212354    2.4928714   -12.705225   -14008.564    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3487003   -1.6743501 
      89    4.9005371   -10.211721   -10.212354    2.4928714   -12.705225   -14008.564    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3487003   -1.6743501 
Loop time of 18.332 on 1 procs for 83 steps with 1500 atoms

Minimization stats:
  Stopping criterion = linesearch alpha is zero
  Energy initial, next-to-last, final = 
         -10.178336106      -10.212354026      -10.212354026
  Force two-norm initial, final = 8831.76 490.29
  Force max component initial, final = 6793.35 484.808
  Final line search alpha, max atom move = 5.03582e-11 2.44141e-08
  Iterations, force evaluations = 83 147

Pair  time (%) = 18.2365 (99.4787)
Neigh time (%) = 0.036432 (0.198734)
Comm  time (%) = 0.0126019 (0.0687423)
Outpt time (%) = 0.00270295 (0.0147444)
Other time (%) = 0.0438213 (0.239042)

Nlocal:    1500 ave 1500 max 1500 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    10100 ave 10100 max 10100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  1.051e+06 ave 1.051e+06 max 1.051e+06 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1051000
Ave neighs/atom = 700.667
Neighbor list builds = 1
Dangerous builds = 0
min_modify	dmax 0.005 line quadratic

#dump		1 all cfg 10 *.cfg id type xs ys zs q vx vy vz fx fy fz
#dump_modify	1 element Hf O

#dump		1 all image 10 image.*.jpg element element #		axes yes 0.8 0.02 view 60 -30
#dump_modify	1 pad 2 element Hf O

velocity	all create 300.1 2398378
run  		10
Memory usage per processor = 10.5175 Mbytes
Step Temp TotEng PotEng E_vdwl E_coul Press Volume Lx Ly Lz Xz q1 q2 
      89        300.1   -10.173589   -10.212354    2.4928714   -12.705225   -10457.266    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      90        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      91        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      92        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      93        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      94        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      95        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      96        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      97        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      98        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
      99        300.1   -10.174236   -10.213001    2.4010801   -12.614081   -16498.516    17203.381    25.450604     25.77244    26.227698   -4.4235975    3.3365845   -1.6682922 
Loop time of 1.70632 on 1 procs for 10 steps with 1500 atoms

Pair  time (%) = 1.23247 (72.23)
Neigh time (%) = 0 (0)
Comm  time (%) = 0.000850201 (0.0498267)
Outpt time (%) = 0.000328779 (0.0192684)
Other time (%) = 0.472666 (27.701)

Nlocal:    1500 ave 1500 max 1500 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    10100 ave 10100 max 10100 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  1.0585e+06 ave 1.0585e+06 max 1.0585e+06 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1058500
Ave neighs/atom = 705.667
Neighbor list builds = 0
Dangerous builds = 0
